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AA01540

100238-42-4 | 4-[2-(1-Piperidinyl)ethoxy] phenol

Packsize Purity Availability Price Discounted Price    Quantity
250mg 95% in stock $715.00 $500.00 -   +
1g 95% in stock $1,192.00 $834.00 -   +

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Description
Catalog Number: AA01540
Chemical Name: 4-[2-(1-Piperidinyl)ethoxy] phenol
CAS Number: 100238-42-4
Molecular Formula: C13H19NO2
Molecular Weight: 221.2955
MDL Number: MFCD06410831
IUPAC Name: 4-(2-piperidin-1-ylethoxy)phenol
InChl: InChI=1S/C13H19NO2/c15-12-4-6-13(7-5-12)16-11-10-14-8-2-1-3-9-14/h4-7,15H,1-3,8-11H2
InChl Key: XGMJHNYRDUELOH-UHFFFAOYSA-N
SMILES: Oc1ccc(cc1)OCCN1CCCCC1

 

Computed Properties
Complexity: 184  
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 221.142g/mol
Formal Charge: 0
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0
Molecular Weight: 221.3g/mol
Monoisotopic Mass: 221.142g/mol
Rotatable Bond Count: 4  
Topological Polar Surface Area: 32.7A^2
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 2.4  

 

 

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